SMILES:
Brc1ccc(-c2cnc3ccccc3n2)cc1Molecular Processing
Molecular formula
C14H9BrN2
Molecular weight
285.14
Exact mass
283.9949
XLogP
4.06
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
17
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
72.67
Supplementary Information
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